(7S)-8-azanyl-7-(4-methyl-1,3-thiazol-2-yl)-10-sulfanyl-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile

Systemtic Name: (7S)-8-azanyl-7-(4-methyl-1,3-thiazol-2-yl)-10-sulfanyl-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile Openeye Name: (7S)-8-amino-7-(4-methylthiazol-2-yl)-10-sulfanyl-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile CAS Name: (7S)-8-amino-10-mercapto-7-(4-methyl-2-thiazolyl)-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile IUPAC Name: (7S)-8-amino-7-(4-methyl-1,3-thiazol-2-yl)-10-sulfanyl-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile Traditional Name: (7S)-8-amino-10-mercapto-7-(4-methylthiazol-2-yl)-9-azoniaspiro[5.5]undeca-8,10-diene-11-carbonitrile Formula: C15H19N4S2+ MolecularWeight: 319.46816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C2C(=[NH+]C(=C(C23CCCCC3)C#N)S)N

Isomeric SMILES

CC1=CSC(=N1)[C@@H]2C(=[NH+]C(=C(C23CCCCC3)C#N)S)N

InChI

InChI=1S/C15H18N4S2/c1-9-8-21-14(18-9)11-12(17)19-13(20)10(7-16)15(11)5-3-2-4-6-15/h8,11,20H,2-6H2,1H3,(H2,17,19)/p+1/t11-/m0/s1